ethyl (E)-3-(1-cyano-7-methyl-2-methylsulfinyl-indolizin-3-yl)prop-2-enoate

Systemtic Name: ethyl (E)-3-(1-cyano-7-methyl-2-methylsulfinyl-indolizin-3-yl)prop-2-enoate Openeye Name: ethyl (E)-3-(1-cyano-7-methyl-2-methylsulfinyl-indolizin-3-yl)prop-2-enoate CAS Name: (E)-3-(1-cyano-7-methyl-2-methylsulfinyl-3-indolizinyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(1-cyano-7-methyl-2-methylsulfinylindolizin-3-yl)prop-2-enoate Traditional Name: (E)-3-(1-cyano-7-methyl-2-methylsulfinyl-indolizin-3-yl)acrylic acid ethyl ester Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(C(=C2N1C=CC(=C2)C)C#N)S(=O)C

Isomeric SMILES

CCOC(=O)/C=C/C1=C(C(=C2N1C=CC(=C2)C)C#N)S(=O)C

InChI

InChI=1S/C16H16N2O3S/c1-4-21-15(19)6-5-13-16(22(3)20)12(10-17)14-9-11(2)7-8-18(13)14/h5-9H,4H2,1-3H3/b6-5+